1-(4-fluorophenyl)-3-methyl-N-(3-methylsulfanylphenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide

Systemtic Name: 1-(4-fluorophenyl)-3-methyl-N-(3-methylsulfanylphenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: 1-(4-fluorophenyl)-3-methyl-N-(3-methylsulfanylphenyl)-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: 1-(4-fluorophenyl)-3-methyl-N-[3-(methylthio)phenyl]-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: 1-(4-fluorophenyl)-3-methyl-N-(3-methylsulfanylphenyl)-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: 1-(4-fluorophenyl)-3-methyl-N-[3-(methylthio)phenyl]-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C22H19FN4OS MolecularWeight: 406.475863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NC2=CC(=CC=C2)SC)N3C=CC=C3)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=NN(C(=C1C(=O)NC2=CC(=CC=C2)SC)N3C=CC=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H19FN4OS/c1-15-20(21(28)24-17-6-5-7-19(14-17)29-2)22(26-12-3-4-13-26)27(25-15)18-10-8-16(23)9-11-18/h3-14H,1-2H3,(H,24,28)